1-(3-chloranyl-2-methyl-phenyl)-3-[(4-nitrophenyl)sulfonylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(4-nitrophenyl)sulfonylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(4-nitrophenyl)sulfonylamino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(4-nitrophenyl)sulfonylamino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(4-nitrophenyl)sulfonylamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-(nosylamino)thiourea Formula: C14H13ClN4O4S2 MolecularWeight: 400.86042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13ClN4O4S2/c1-9-12(15)3-2-4-13(9)16-14(24)17-18-25(22,23)11-7-5-10(6-8-11)19(20)21/h2-8,18H,1H3,(H2,16,17,24)